Vitas-M small molecule compound

methyl 4-[(4-chloro-2-fluorophenyl)amino]-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate

Catalog ID
STK064049
SMILES COC(=O)C(C(F)(F)F)(CC(=O)Nc1ccc(cc1F)Cl)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H10ClF4NO4 MW 343.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10ClF4NO4/c1-22-10(20)11(21,12(15,16)17)5-9(19)18-8-3-2-6(13)4-7(8)14/h2-4,21H,5H2,1H3,(H,18,19)
InChIKey
VMPZEXAAZRMGSJ-UHFFFAOYSA-N
Synonyms
404899-78-1
404899781
COC(=O)C(C(F)(F)F)(CC(=O)Nc1ccc(cc1F)Cl)O
COC(=O)C(CC(=O)NC1=C(C=C(C=C1)Cl)F)(C(F)(F)F)O
InChI=1SC12H10ClF4NO4c12210(20)11(2112(1516)17)59(19)188326(13)47(8)14h2421H5H21H3(H1819)
METHYL(2R)4((4CHLORO2FLUOROPHENYL)AMINO)2HYDROXY4OXO2(TRIFLUOROMETHYL)BUTANOATE
METHYL(2S)4((4CHLORO2FLUOROPHENYL)AMINO)2HYDROXY4OXO2(TRIFLUOROMETHYL)BUTANOATE
METHYL4((4CHLORO2FLUOROPHENYL)AMINO)2HYDROXY4OXO2(TRIFLUOROMETHYL)BUTANOATE
METHYL4(4CHLORO2FLUOROANILINO)2HYDROXY4OXO2(TRIFLUOROMETHYL)BUTANOATE
MFCD02175396
STK064049
ZINC000002766974
ZINC000002766975

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.